Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.59 |
| ▸ | ATM | Q13315 | 4/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | CNR1 | P21554 | 2/20 | 0.59 |
| ▸ | CNR2 | P34972 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7936838 | 0.84 | TUBB4A (0.57) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL28506836 | 0.81 | TDP1 (0.46) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL28356006 | 0.81 | TDP1 (0.46) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL6808979 | 0.81 | ATM (0.59) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL6597757 | 0.81 | L3MBTL1 (0.59) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL6594160 | 0.79 | TUBB4A (0.59) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL7945825 | 0.79 | ESR1 (0.53) | TDP1L3MBTL1CNR1CNR2 | |
| SCHEMBL11556150 | 0.78 | L3MBTL1 (0.57) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL28519702 | 0.78 | TDP1 (0.42) | TDP1L3MBTL1ATMHPGDCNR1 | |
| SCHEMBL28907137 | 0.78 | TDP1 (0.42) | TDP1L3MBTL1ATMHPGDCNR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110656346-B | Method for continuously preparing 2-aryl-3-halogenated-benzothiophene compound by using electrochemical microchannel reaction device | 南京工业大学 | 2021-02-02 | — | — | CN | disclosed |
| CN-110656346-A | Method for continuously preparing 2-aryl-3-halogenated-benzothiophene compound by using electrochemical microchannel reaction device | 南京工业大学 | 2020-01-07 | — | — | CN | disclosed |